[5-(Methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl]{(1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl}methanone | CAS No. 1421936-85-7

[5-(Methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl]{(1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl}methanone

Basic Information

CAS Number

1421936-85-7

Molecular Formula

C20H18F6N2O5S

Molecular Weight

512.43 g/mol

AD

Basic Physical Properties

C[C@@H](Oc1ccc(cc1C(=O)N2C[C@@H]3C[C@@]3(C2)c4cc(on4)C(F)(F)F)S(=O)(=O)C)C(F)(F)F

InChI

InChI=1S/C20H18F6N2O5S/c1-10(19(21,22)23)32-14-4-3-12(34(2,30)31)5-13(14)17(29)28-8-11-7-18(11,9-28)15-6-16(33-27-15)20(24,25)26/h3-6,10-11H,7-9H2,1-2H3/t10-,11+,18+/m1/s1

InChIKey

MYHDQTVHHMSLEF-DDBGAENHSA-N

LogP

3.840200000000003

Topological Polar Surface Area

89.71000000000001 Ų

Hydrogen Bond Donor/Acceptor

0 / 7

Complexity

907

Synonyms & References

English

  • M43ZDU10DD
  • Iclepertin
  • Iclepertin [INN]
  • Methanone, (5-(methylsulfonyl)-2-((1R)-2,2,2-trifluoro-1-methylethoxy)phenyl)((1R,5R)-1-(5-(trifluoromethyl)-3-isoxazolyl)-3-azabicyclo(3.1.0)hex-3-yl)-
  • Unii-M43zdu10DD

MDL Number

MFCD34474019

FAQ

What is (1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl (5-(methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl)methanone (CAS: 1421936-85-7)?

It is a complex organic compound with a specific structure that includes a 1,2-oxazole ring, azabicyclo[3.1.0]hexane, and phenolic groups. This compound is characterized by its trifluoromethyl and methylsulfonyl substituents, which contribute to its unique chemical properties.

What are the main uses of (1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl (5-(methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl)methanone (CAS: 1421936-85-7)?

This compound is primarily used in pharmaceuticals for developing innovative drug candidates due to its unique structural features. It may also have applications in other fields like materials science and research where specific chemical properties are required.

Is (1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl (5-(methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl)methanone (CAS: 1421936-85-7) safe?

The safety of this compound depends on the intended use and handling methods. Proper handling and storage guidelines must be followed to minimize risks. Always consult safety data sheets (SDS) for detailed information on safety measures.

How should (1R,5R)-1-[5-(trifluoromethyl)-1,2-oxazol-3-yl]-3-azabicyclo[3.1.0]hex-3-yl (5-(methylsulfonyl)-2-{[(2R)-1,1,1-trifluoro-2-propanyl]oxy}phenyl)methanone (CAS: 1421936-85-7) be stored?

This compound should be stored in a cool, dry place away from direct sunlight and heat sources. Maintain a temperature below 25°C and keep in a tightly sealed container to prevent degradation. Avoid contact with incompatible materials and ensure proper ventilation during handling.

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